3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid
TL;DR: 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid (CAS 330950-71-5) is a chemical compound with molecular formula C21H14ClN3O2 and molecular weight 375.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid
Also Known As: 3-((6-chloro-4-phenylquinazolin-2-yl)amino)benzoic acid, 3-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid, BAS 01118284, AB00667739-01, F0394-0005
| Molecular Formula | C21H14ClN3O2 |
|---|---|
| Molecular Weight | 375.08 g/mol |
| LogP | 5.392 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.07745 |
| Heavy Atoms | 27 |
| Complexity | 1146.7004 |
Chemical Identifiers
| CAS Number | 330950-71-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)NC4=CC=CC(=C4)C(=O)O |
Product Overview
3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid (CAS 330950-71-5), with molecular formula C21H14ClN3O2 and molecular weight 375.08 g/mol. IUPAC: 3-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid.
Chemical Property Profile of 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid
Property Insights of 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid
The XLogP value of 5.392 indicates that 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid. Following Lipinski's Rule of Five, 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid?
The CAS number of 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid is 330950-71-5.
What is the molecular formula of 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid?
The molecular formula of 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid is C21H14ClN3O2.
What is the molecular weight of 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid?
The molecular weight of 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid is 375.08 g/mol.
Where can I buy 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid?
You can request a quote for 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((6-Chloro-4-phenylquinazolin-2-yl)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.